Base information
| Cat. No. | |
| CAS No. | 5468-37-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10ClNO |
| Molecular Weight | 171.624 |
| Exact Mass | 171.045 |
| XLogP3 | 2.3303 |
| Mr | 46.3089 |
| PSA | 43.09 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NCC(=O)c1ccccc1.Cl |
